Glycoside
GD078470
Name:
NoneFormula:
C20H26O6N2Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)CCc2cnc3ccccc3c2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(CCc1cnc2ccccc2c1)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | 0.13 | Num_rotatable_bonds: | 7 |
| MolWt: | 390.44 | Num_heavy_atoms: | 28 |
| TPSA: | 121.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD36037
Formula: C14H16O2N2
Smiles:
O=C(CCc1cnc2ccccc2c1)NCCO| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 1.28 | Num_rotatable_bonds: | 5 |
| MolWt: | 244.29 | Num_heavy_atoms: | 18 |
| TPSA: | 62.22 | NumAromaticRings: | 2 |
